N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide

C17H26N2O3S — CID 37154343

IUPACN-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide
SMILESCCCCN(C)C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C17H26N2O3S/c1-3-4-12-19(2)17(20)14-8-7-11-16(13-14)23(21,22)18-15-9-5-6-10-15/h7-8,11,13,15,18H,3-6,9-10,12H2,1-2H3
InChIKeyDTLIJRFVTWBSRQ-UHFFFAOYSA-N
MW338.47 g/mol
LogP2.78
Rot. Bonds7

About N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide

N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide (PubChem CID 37154343) has the molecular formula C17H26N2O3S and a molecular weight of 338.47 g/mol. Its IUPAC name is N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide.

Molecular Properties

Compound NameN-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide
PubChem CID37154343
Molecular FormulaC17H26N2O3S
Molecular Weight338.47 g/mol
Exact Mass338.17
IUPAC NameN-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide
SMILESCCCCN(C)C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C17H26N2O3S/c1-3-4-12-19(2)17(20)14-8-7-11-16(13-14)23(21,22)18-15-9-5-6-10-15/h7-8,11,13,15,18H,3-6,9-10,12H2,1-2H3
InChIKeyDTLIJRFVTWBSRQ-UHFFFAOYSA-N
XLogP2.78
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.47
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopentylsulfamoyl)-N-methyl-N-[3-(3-phenyl-1H-pyrazol-5-yl)propyl]benzamide
CID 55814945
3-[[3-(cyclopentylsulfamoyl)benzoyl]-ethylamino]propanoic acid
CID 119191474
3-(cyclopentylsulfamoyl)-N-ethylbenzamide
CID 30830540
3-(cyclobutylsulfamoyl)-N-methyl-N-(oxan-2-ylmethyl)benzamide
CID 72939295
3-(cyclopentylsulfamoyl)-N-[(2,3-dichlorophenyl)methyl]-N-methylbenzamide
CID 46577867
N-butyl-3-[(4-methoxyphenyl)sulfamoyl]-N-methylbenzamide
CID 17480264
N-butyl-N-methyl-3-[(4-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109065512
3-(1,3-benzodioxol-5-ylsulfamoyl)-N-butyl-N-methylbenzamide
CID 32904387
N-butyl-3-[4-(cyclopentylsulfamoyl)phenyl]-N-methylpropanamide
CID 110355911
N-butyl-3-(3-methoxypropylsulfamoyl)-N-methylbenzamide
CID 109063745
N-butyl-N-methyl-3-[(4-methylphenyl)methylsulfamoyl]benzamide
CID 109064605
N-(1-cyanocyclobutyl)-3-(cyclopentylsulfamoyl)-N-methylbenzamide
CID 71884484

Frequently Asked Questions

What is the IUPAC name of N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide?
The IUPAC name of N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide (CID 37154343) is N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide.
What is the SMILES notation for N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide?
The canonical SMILES for N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide is CCCCN(C)C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1.
What is the InChIKey of N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide?
The InChIKey is DTLIJRFVTWBSRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3S/c1-3-4-12-19(2)17(20)14-8-7-11-16(13-14)23(21,22)18-15-9-5-6-10-15/h7-8,11,13,15,18H,3-6,9-10,12H2,1-2H3.
What are the key properties of N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide?
N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide has a molecular weight of 338.47 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-3-(cyclopentylsulfamoyl)-N-methylbenzamide is sourced from PubChem (CID 37154343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).